A3413/0144798
TL;DR: A3413/0144798 (CAS 1031247-40-1) is a chemical compound with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[(2-chlorophenyl)methyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide
Also Known As: A3413/0144798, 2-[3-(2-chlorobenzyl)-5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide, 2-(3-(2-chlorobenzyl)-5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)-N-(4-ethoxyphenyl)acetamide, 2-[3-[(2-chlorophenyl)methyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide, 2-{3-[(2-CHLOROPHENYL)METHYL]-5-OXO-1-PHENYL-2-SULFANYLIDENEIMIDAZOLIDIN-4-YL}-N-(4-ETHOXYPHENYL)ACETAMIDE
| Molecular Formula | C26H24ClN3O3S |
|---|---|
| Molecular Weight | 493.12 g/mol |
| LogP | 5.2698 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 493.12268 |
| Heavy Atoms | 34 |
| Complexity | 1187.4099 |
Chemical Identifiers
| CAS Number | 1031247-40-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CC3=CC=CC=C3Cl)C4=CC=CC=C4 |
Product Overview
A3413/0144798 (CAS 1031247-40-1), with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol. IUPAC: 2-[3-[(2-chlorophenyl)methyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl]-N-(4-ethoxyphenyl)acetamide.
Chemical Property Profile of A3413/0144798
Property Insights of A3413/0144798
The XLogP value of 5.2698 indicates that A3413/0144798 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for A3413/0144798. Following Lipinski's Rule of Five, A3413/0144798 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3413/0144798?
The CAS number of A3413/0144798 is 1031247-40-1.
What is the molecular formula of A3413/0144798?
The molecular formula of A3413/0144798 is C26H24ClN3O3S.
What is the molecular weight of A3413/0144798?
The molecular weight of A3413/0144798 is 493.12 g/mol.
Where can I buy A3413/0144798?
You can request a quote for A3413/0144798 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3413/0144798?
Yes, KEHONG BIO provides custom synthesis services for A3413/0144798 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.